HCID13933712

1-(2,3,5,6-Tetrafluoro-4-trifluoromethyl phenyl)-5-methylcarbonylamino-4-nitropyrazole

N-[4-nitro-1-[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]pyrazol-5-yl]acetamide

C12H5F7N4O3386.18 g/mol

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IDENTITY

结构与身份

标准SMILES: CC(=O)Nc1c([N+](=O)[O-])cnn1-c1c(F)c(F)c(C(F)(F)F)c(F)c1F
InChIKey: PECDBTGQAWSXOD-UHFFFAOYSA-N
分子式: C12H5F7N4O3
平均分子量: 386.18 g/mol
单同位素质量: 386.02498717

COMPUTED

结构计算性质

已同步

XLogP: 3.1
极性表面积: 92.7 Å²
氢键供体: 1
氢键受体: 11
可旋转键: 2
重原子: 26
形式电荷: 0
复杂度: 544

ALIASES

名称与别名

共 4 条

1-(2,3,5,6-tetrafluoro-4-trifluoromethyl phenyl)-5-methylcarbonylamino-4-nitropyrazoleSCHEMBL95859831-(2,3,5,6-tetrafluoro-4-trifluoromethylphenyl) -5-methylcarbonylamino-4-nitropyrazole5-acetamido-4-nitro-1-(2,3,5,6-tetrafluoro-4-trifluoromethyl-phenyl)-pyrazole

REACTIONS